| CAS Number | 1638951-93-5 |
| Catalog Number | AG01DVSL |
| Chemical Name | 4-bromo-2-ethoxy-6-fluorobenzaldehyde |
| IUPAC Name | 4-bromo-2-ethoxy-6-fluorobenzaldehyde |
| InChI | InChI=1S/C9H8BrFO2/c1-2-13-9-4-6(10)3-8(11)7(9)5-12/h3-5H,2H2,1H3 |
| InChI Key | PCVSUPHHCNMYTQ-UHFFFAOYSA-N |
| MDL Number | MFCD30468995 |
| Molecular Formula | C9H8BrFO2 |
| Molecular Weight | 247.0610 |
| SMILES | BrC1=CC(=C(C=O)C(=C1)F)OCC |
| Synonyms | 4-bromo-2-ethoxy-6-fluorobenzaldehyde,
1638951-93-5,
SCHEMBL16269517,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.969g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.063g/mol |
| Monoisotopic Mass | 245.969g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number